SCHEMBL9874613

SCHEMBL9874613

CCOC(=O)C(=CNc1ccc(Cl)cc1)C(=O)c1ccc(Cl)cc1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 5/20 0.63
NPSR1 Q6W5P4 4/20 0.56
HPGD P15428 3/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
GAA P10253 3/20 0.51
ALDH1A1 P00352 2/20 0.51
TDP1 Q9NUW8 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
KDM4E B2RXH2 4/20 0.50
MEN1 O00255 1/20 0.50
NPY1R P25929 1/20 0.50
NPY2R P49146 1/20 0.50
KMT2A Q03164 1/20 0.50
MAPT P10636 3/20 0.48
RECQL P46063 1/20 0.48
LMNA P02545 1/20 0.46
HTT P42858 1/20 0.46
CYP19A1 P11511 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9873320 0.94 DHODH (0.59) DHODHNPSR1HPGDL3MBTL1GAA
SCHEMBL10863680 0.90 DHODH (0.77) DHODHNPSR1HPGDL3MBTL1GAA
SCHEMBL11084961 0.86 DHODH (0.67) DHODHNPSR1HPGDL3MBTL1GAA
SCHEMBL13885846 0.85 DHODH (0.58) DHODHNPSR1HPGDL3MBTL1GAA
SCHEMBL13885851 0.85 DHODH (0.58) DHODHNPSR1HPGDL3MBTL1GAA
SCHEMBL3565253 0.85 DHODH (0.58) DHODHNPSR1HPGDL3MBTL1GAA
SCHEMBL3565256 0.85 DHODH (0.58) DHODHNPSR1HPGDL3MBTL1GAA
SCHEMBL29254508 0.83 DHODH (0.64) DHODHNPSR1L3MBTL1GAAALDH1A1
SCHEMBL10863692 0.82 DHODH (0.90) DHODHNPSR1HPGDL3MBTL1GAA
SCHEMBL29254476 0.81 DHODH (0.57) DHODHNPSR1L3MBTL1GAAALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5026711-A Prevention and treatment of cardiovascular disorders and infections states; anxiolytic and anti-allergic agents SANOFI (FR) 1991-06-25 US disclosed